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methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate structure
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methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate

TL;DR: methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate (CAS 1173678-01-7) is a chemical compound with molecular formula C16H23N3O4 and molecular weight 321.16885 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

methyl (2S)-2-[(4-acetamidophenyl)carbamoylamino]-4-methylpentanoate

Also Known As: methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate, (S)-methyl 2-(3-(4-acetamidophenyl)ureido)-4-methylpentanoate, methyl (2S)-2-[(4-acetamidophenyl)carbamoylamino]-4-methylpentanoate

CAS Number
1173678-01-7
Molecular Formula
C16H23N3O4
Molecular Weight
321.16885 g/mol
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Technical Specifications

Molecular FormulaC16H23N3O4
Molecular Weight321.16885 g/mol
XLogP1.7
Topological Polar Surface Area (TPSA)96.5 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds7
Exact Mass321.16885 Da
Heavy Atoms23
Complexity418.0
SMILESCC(C)C[C@@H](C(=O)OC)NC(=O)NC1=CC=C(C=C1)NC(=O)C
InChIKeyASGPEMAGVIEECJ-AWEZNQCLSA-N

Chemical Property Profile of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate

XLogP
1.7
TPSA (Topological Polar Surface Area)
96.5
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
7
Heavy Atoms
23
Complexity
418.0
Exact Mass
321.16885
Monoisotopic Mass
321.16885
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate

The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate. Following Lipinski's Rule of Five, methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate?

The CAS number of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate is 1173678-01-7.

What is the molecular formula of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate?

The molecular formula of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate is C16H23N3O4.

What is the molecular weight of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate?

The molecular weight of methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate is 321.16885 g/mol.

Where can I buy methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate?

You can request a quote for methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate?

Yes, CoreyChem provides custom synthesis services for methyl N-{[4-(acetylamino)phenyl]carbamoyl}-L-leucinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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